2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide

C15H21FN2O2 — CID 79853728

IUPAC2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(F)cc1C(C)NC(=O)CC1(N)CCC1
InChIInChI=1S/C15H21FN2O2/c1-10(12-8-11(16)4-5-13(12)20-2)18-14(19)9-15(17)6-3-7-15/h4-5,8,10H,3,6-7,9,17H2,1-2H3,(H,18,19)
InChIKeyCMXDJDMDYGBBSU-UHFFFAOYSA-N
MW280.34 g/mol
LogP2.28
Rot. Bonds5

About 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide

2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide (PubChem CID 79853728) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
PubChem CID79853728
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(F)cc1C(C)NC(=O)CC1(N)CCC1
InChIInChI=1S/C15H21FN2O2/c1-10(12-8-11(16)4-5-13(12)20-2)18-14(19)9-15(17)6-3-7-15/h4-5,8,10H,3,6-7,9,17H2,1-2H3,(H,18,19)
InChIKeyCMXDJDMDYGBBSU-UHFFFAOYSA-N
XLogP2.28
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclohexyl)-N-[1-(2,5-difluorophenyl)ethyl]acetamide
CID 64684210
2-(1-aminocyclobutyl)-N-[(1R)-1-(2-fluorophenyl)ethyl]acetamide
CID 81379814
2-chloro-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide
CID 43701037
3-amino-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]oxolane-3-carboxamide
CID 64892125
(2R)-2-amino-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]propanamide;hydrochloride
CID 119292617
N-[1-(5-fluoro-2-methoxyphenyl)ethyl]-2-thiomorpholin-3-ylacetamide
CID 66422032
2-bromo-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]-3-methylbutanamide
CID 43701042
2-(1-hydroxycyclohexyl)-N-[1-(2-methoxy-5-methylphenyl)ethyl]acetamide
CID 111331644
methyl 2-[1-(5-fluoro-2-methoxyphenyl)ethylamino]butanoate
CID 115282443
2-(1-aminocyclopentyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81363183
1-[2-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 40896538
2-(1-aminocyclobutyl)-N-(1-phenylethyl)acetamide
CID 79851717

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide (CID 79853728) is 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide is COc1ccc(F)cc1C(C)NC(=O)CC1(N)CCC1.
What is the InChIKey of 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
The InChIKey is CMXDJDMDYGBBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-10(12-8-11(16)4-5-13(12)20-2)18-14(19)9-15(17)6-3-7-15/h4-5,8,10H,3,6-7,9,17H2,1-2H3,(H,18,19).
What are the key properties of 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide?
2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide has a molecular weight of 280.34 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 79853728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).